(3aS,8S,8aR)-3a-hydroxy-2,2,8-trimethyl-1,3,8,8a-tetrahydroazulene-5,6-dicarbaldehyde
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(3aS,8S,8aR)-3a-hydroxy-2,2,8-trimethyl-1,3,8,8a-tetrahydroazulene-5,6-dicarbaldehyde
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CAS No:
96910-73-5
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Formula:
C15H20O3
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Chemical Name:
(3aS,8S,8aR)-3a-hydroxy-2,2,8-trimethyl-1,3,8,8a-tetrahydroazulene-5,6-dicarbaldehyde
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Synonyms:
9-Hydroxyvelleral;96910-73-5;CCRIS 1707;5,6-Azulenedicarboxaldehyde, 1,2,3,3a,8,8a-hexahydro-3a-hydroxy-2,2,8-trimethyl-, (3aS-(3a-alpha,8-alpha,8a-alpha))-;DTXSID40242624;(3aS,8S,8aR)-3a-hydroxy-2,2,8-trimethyl-1,3,8,8a-tetrahydroazulene-5,6-dicarbaldehyde;(3aS)-1,2,3,3a,8,8aalpha-Hexahydro-2,2,8alpha-trimethyl-3aalpha-hydroxyazulene-5,6-dicarbaldehyde
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CAS No:
(3aS,8S,8aR)-3a-hydroxy-2,2,8-trimethyl-1,3,8,8a-tetrahydroazulene-5,6-dicarbaldehyde Basic Attributes
248.32 g/mol
248.14124450 g/mol
DTXSID40242624
Computed Properties
Molecular Weight:248.32
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:248.14124450
Monoisotopic Mass:248.14124450
Topological Polar Surface Area:54.4
Heavy Atom Count:18
Complexity:445
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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